%chk=000177881.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177881

0 1
 O    3.548900      0.3840000      -1.917000    
 O    3.676700     -0.5867000       1.630900    
 O    2.567500       2.018900       1.192500    
 O    2.212800      -2.643900      0.7665000    
 O  -0.1520000       2.664100     -6.8999998E-02
 O  -0.2739000      -2.657400     -0.3719000    
 O   -2.812200      -2.704400     -0.1497000    
 O   -5.036600       1.468100      0.1445000    
 C    3.620000      0.6087000     -0.5011000    
 C    3.605300     -0.7544000      0.2144000    
 C    2.378000       1.442100     -0.1001000    
 C    2.327600      -1.541600     -0.1339000    
 C    1.089000      0.6388000     -8.0700003E-02
 C    1.062800     -0.7062000     -0.1168000    
 C    4.921300       1.378700     -0.2401000    
 C  -0.1718000       1.438000     -6.8200000E-02
 C  -0.2335000      -1.442700     -0.2082000    
 C   -1.454500      0.7174000     -4.3099999E-02
 C   -1.484200     -0.6722000     -0.1101000    
 C   -2.712400      -1.345600     -9.3199998E-02
 C   -2.652200       1.439100      4.1700002E-02
 C   -3.873600      0.7657000      6.0500000E-02
 C   -3.903700     -0.6250000     -6.8999999E-03
 C   -6.249300      0.7166000      0.1590000    
 H    4.467800      -1.364100     -8.2800001E-02
 H    2.272100       2.267100     -0.8160000    
 H    2.432000      -1.965600      -1.140100    
 H    5.784500      0.8011000     -0.5905000    
 H    4.930600       2.318500     -0.8043000    
 H    5.073900       1.613100      0.8173000    
 H    2.658600      7.6899998E-02  -2.152700    
 H    4.571200     -0.2744000       1.847000    
 H    2.652700       1.295500       1.836900    
 H    2.150500      -2.284000       1.668000    
 H   -2.648900       2.525100      9.4599999E-02
 H   -4.821900      -1.203400      4.3000001E-03
 H   -1.937300      -3.115300     -8.2599998E-02
 H   -7.073100       1.434400      0.2294000    
 H   -6.312500      7.1099997E-02   1.041600    
 H   -6.389700      0.1603000     -0.7740000    


%chk=000177881-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000177881

0 1
O 3.351532 0.367571 -1.963603
O 3.832285 -0.545843 1.665403
O 2.624363 1.910608 1.441522
O 2.207494 -2.504907 1.187858
O -0.147860 2.731250 -0.130306
O -0.214464 -2.728319 -0.455351
O -2.756195 -2.772690 -0.372264
O -5.060350 1.486552 0.154526
C 3.566506 0.632577 -0.520358
C 3.637086 -0.747312 0.192427
C 2.379917 1.459075 0.059625
C 2.325273 -1.579362 0.054533
C 1.080625 0.663519 -0.005150
C 1.065451 -0.716005 -0.042151
C 4.889163 1.398276 -0.444452
C -0.188775 1.464636 -0.045995
C -0.219362 -1.451847 -0.212288
C -1.483159 0.714550 -0.016455
C -1.468976 -0.710781 -0.136608
C -2.720011 -1.414244 -0.202557
C -2.692697 1.412909 0.070192
C -3.925066 0.692188 0.045420
C -3.946663 -0.711426 -0.094990
C -6.373877 0.826497 0.131262
H 4.482909 -1.333013 -0.212255
H 2.258964 2.392127 -0.515607
H 2.388216 -2.227912 -0.835376
H 5.724185 0.767500 -0.799027
H 4.833279 2.284281 -1.098702
H 5.088634 1.747189 0.582765
H 2.397798 0.140008 -2.122009
H 4.794651 -0.554187 1.883915
H 2.928101 1.104735 1.950657
H 2.603173 -2.019997 1.967167
H -2.697626 2.503335 0.146146
H -4.872468 -1.289172 -0.137471
H -1.769872 -3.092928 -0.457971
H -7.103165 1.641415 0.239126
H -6.473761 0.115538 0.972781
H -6.534759 0.300008 -0.828276


